Project name: query_structure

Chain sequence(s)	A: GLPVCGETCVGGTCNTPGCVCSWPVCTRN
Selected Chain(s)	A
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:03)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:03)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:03)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:03)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:03)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:12)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:12)

• Minimal score value: -1.0997
• Maximal score value: 1.714
• Average score: 0.2377
• Total score value: 6.8938

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index	residue name	chain	Aggrescan3D score	mutation
1	G	A	-0.2439
2	L	A	1.1162
3	P	A	1.0558
4	V	A	1.4590
5	C	A	0.6205
6	G	A	-0.5050
7	E	A	-0.8326
8	T	A	0.0903
9	C	A	0.0000
10	V	A	1.6393
11	G	A	0.1434
12	G	A	-0.4114
13	T	A	0.0344
14	C	A	0.0000
15	N	A	-0.9396
16	T	A	-0.6372
17	P	A	-0.5754
18	G	A	-0.7740
19	C	A	0.0000
20	V	A	0.9173
21	C	A	0.9303
22	S	A	1.0434
23	W	A	1.7140
24	P	A	0.9258
25	V	A	1.0458
26	C	A	0.0000
27	T	A	0.5829
28	R	A	-0.4058
29	N	A	-1.0997